Information card for entry 4341760

Structure parameters

• Common name: Gold/Palladium Carbonyl Phosphine Cluster
• Formula: C102 H180 Au2 O30 P12 Pd42
• Calculated formula: C102 H180 Au2 O30 P12 Pd42
• Title of publication: Acid/Base-Controlled Au(I)/Au(0) Reductive Transformations of the Monogold [(μ14-Au)Pd22(CO)20(PEt3)8](+) Monocation into Three Different Neutral Digold Nanoclusters: Au2Pd21(CO)20(PEt3)10, Au2Pd28(CO)26(PEt3)10, and New Five-Layer Hexagonal Close-Packed (μ12-Au)2Pd42(CO)30(PEt3)12 with a Trigonal-Bipyramidal AuPd3Au Kernel.
• Authors of publication: Mednikov, Evgueni G.; Dahl, Lawrence F.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 3
• Pages of publication: 1145 - 1151
• a: 28.2643 ± 0.001 Å
• b: 28.2643 ± 0.001 Å
• c: 36.1195 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 24989 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0779
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1572
• Weighted residual factors for all reflections included in the refinement: 0.1696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No